Wrong amide N Java regex correction

Change-Id: Iafe1f78c4810ec7a3cd1ead0ed7feaa045313f21 Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
cdk · May 5, 2012 · d7338ec · d7338ec
1 parent ea828a9
commit d7338ec
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/src/main/org/openscience/cdk/modeling/builder3d/MMFF94BasedAtomTypePattern.java b/src/main/org/openscience/cdk/modeling/builder3d/MMFF94BasedAtomTypePattern.java
@@ -164,7 +164,7 @@ private void createPattern() {
 		//n no2
 		atomTypePatterns.add(Pattern.compile("N-2;[A-Z[^O]]{0,1}=O[A-Z[^O]]{0,1}[(].*+"));
 		//n N=O
-		atomTypePatterns.add(Pattern.compile("N-[1-3];[CH]{1,3}.{1}+[A-Z]{0,3}+[,]?+=OC.*+"));
+		atomTypePatterns.add(Pattern.compile("N-[1-3];[CH]{1,3}.{1}+[A-Z]{0,3}+[,]?+=O[CNX].*+"));
 		//NC=0 amid 
 		atomTypePatterns.add(Pattern.compile("N-1-2];[CH]{1}+=S[(].*+"));
 		//NSO (50)